Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL31606418 | 0.82 | ALDH1A1 (0.41) | ALDH1A1TDP1POLBL3MBTL1MEN1 | |
| SCHEMBL813858 | 0.82 | ALDH1A1 (0.41) | ALDH1A1TDP1POLBL3MBTL1MEN1 | |
| SCHEMBL2408381 | 0.78 | TRPV6 (0.42) | ALDH1A1TDP1POLBL3MBTL1MEN1 | |
| SCHEMBL32674542 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TDP1POLBL3MBTL1MEN1 | |
| SCHEMBL8851761 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TDP1POLBL3MBTL1MEN1 | |
| SCHEMBL29410834 | 0.78 | ENPP2 (0.41) | ALDH1A1TDP1POLBL3MBTL1MEN1 | |
| SCHEMBL4288 | 0.78 | ENPP2 (0.41) | ALDH1A1TDP1POLBL3MBTL1MEN1 | |
| SCHEMBL8852075 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TDP1POLBL3MBTL1MEN1 | |
| SCHEMBL7631820 | 0.75 | TRPV6 (0.39) | ALDH1A1TDP1POLBL3MBTL1MEN1 | |
| SCHEMBL63469 | 0.74 | ALDH1A1 (0.52) | ALDH1A1TDP1POLBL3MBTL1MEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011031401-A2 | LITHIUM NON-FLUORINATED AND FLUORINATED PHENYL TRIFLUORO BORATE SALTS FOR NON-AQUEOUS BATTERY ELECTROLYTES | BROOKHAVEN SCIENCE ASSOCIATES LLC (US) | 2011-03-17 | — | — | WO | disclosed |